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90174-29-1 | Pyridine, 4-[[2-(2-methoxy-1-naphthalenyl)-3-thiazolidinyl]methyl]-
CAS No: 90174-29-1 Catalog No: AG00H64J MDL No:
Product Description
Catalog Number:
AG00H64J
Chemical Name:
Pyridine, 4-[[2-(2-methoxy-1-naphthalenyl)-3-thiazolidinyl]methyl]-
CAS Number:
90174-29-1
Molecular Formula:
C20H20N2OS
Molecular Weight:
336.4506
IUPAC Name:
2-(2-methoxynaphthalen-1-yl)-3-(pyridin-4-ylmethyl)-1,3-thiazolidine
InChI:
InChI=1S/C20H20N2OS/c1-23-18-7-6-16-4-2-3-5-17(16)19(18)20-22(12-13-24-20)14-15-8-10-21-11-9-15/h2-11,20H,12-14H2,1H3
InChI Key:
HAGBZLLNMCSFGA-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1C1SCCN1Cc1ccncc1)cccc2
Properties
Complexity:
401
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
336.13g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
336.453g/mol
Monoisotopic Mass:
336.13g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
50.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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